7DOQ
Lp major histidine acid phosphatase mutant D281A/5'-AMP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 298.15 |
| Detector technology | CCD |
| Collection date | 2016-12-17 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.978 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 91.498, 56.479, 146.349 |
| Unit cell angles | 90.00, 110.01, 90.00 |
Refinement procedure
| Resolution | 35.620 - 2.200 |
| R-factor | 0.1935 |
| Rwork | 0.192 |
| R-free | 0.22930 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3it0 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.398 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 35.620 | 2.255 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.082 | 0.479 |
| Number of reflections | 66012 | 4815 |
| <I/σ(I)> | 11.6 | |
| Completeness [%] | 96.4 | |
| Redundancy | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289.15 | 20% w/v Polyethylene glycol 3350, 0.2M Sodium formate, 0.025% (w/v) low gelling temperature agarose |
